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81319-48-4

81319-48-4 structural image
Product Name: Tetronolide, 10-O-(4-(acetylamino)-2,3,4,6-tetradeoxy-3-C-methyl-3-nit rohexopyranosyl)-, 13-acetate
Formula: C43H56N2O13
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COMPUTED DESCRIPTORS

Molecular Weight 824.9 g/mol
XLogP3 4.4
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 14
Rotatable Bond Count 7
Exact Mass 824.37315446 g/mol
Monoisotopic Mass 824.37315446 g/mol
Topological Polar Surface Area 230 Ų
Heavy Atom Count 59
Formal Charge 0
Complexity 1950
Isotope Atom Count 0
Defined Atom Stereocenter Count 14
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 3
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes